Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5162780 | 0.83 | LMNA (0.59) | LMNAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL4717946 | 0.79 | NQO2 (0.54) | LMNAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL10348018 | 0.79 | ALDH1A1 (0.54) | LMNAALDH1A1MAPTKMT2AGAA | |
| SCHEMBL2162246 | 0.77 | KEAP1 (0.48) | LMNAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL5309632 | 0.75 | MPO (0.56) | HSD17B10HIF1A | |
| SCHEMBL9126314 | 0.75 | MTNR1A (0.55) | GAAHPGDMTNR1AMTNR1BNQO2 | |
| SCHEMBL17846112 | 0.75 | MTNR1A (0.45) | ALDH1A1MAPTL3MBTL1KMT2AMTNR1A | |
| SCHEMBL2942164 | 0.74 | KMT2A (0.44) | LMNAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL8697987 | 0.74 | ALDH1A1 (0.51) | LMNAALDH1A1MAPTL3MBTL1KMT2A | |
| SCHEMBL6921461 | 0.74 | CYP1A2 (0.49) | LMNAKMT2AMTNR1AMTNR1BMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2770987-A1 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2014-09-03 | — | — | EP | disclosed |
| WO-2013063214-A1 | NOVEL COMPOUNDS THAT ARE ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-05-02 | — | — | WO | disclosed |